In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 16 | Yes |
Popular Name: N-(2-imidazol-1-ylethyl)-3-methyl-isothiazole-4-carboxamide N-(2-imidazol-1-ylethyl)-3-methy…
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Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.09 | 4.8 | -43.75 | 2 | 5 | 1 | 61 | 237.308 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.09 | 4.29 | -16.17 | 1 | 5 | 0 | 60 | 236.3 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.